SCHEMBL2419692

SCHEMBL2419692

FC(F)(F)c1cnc2nc(Cl)[nH]c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.54
HSD17B10 Q99714 1/20 0.54
AURKA O14965 1/20 0.51
KCNH2 Q12809 1/20 0.42
METAP2 P50579 1/20 0.41
ALDH1A1 P00352 4/20 0.39
JUN P05412 1/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
PLAU P00749 1/20 0.37
POLB P06746 1/20 0.37
NPBWR1 P48145 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
CBFB Q13951 1/20 0.36
GAA P10253 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11773659 0.81 HSD17B10 (0.70) HTTHSD17B10AURKAKCNH2METAP2
SCHEMBL10146396 0.79 AURKA (0.58) HTTHSD17B10AURKAKCNH2METAP2
SCHEMBL29954536 0.76 AURKA (0.48) HTTHSD17B10AURKAKCNH2METAP2
SCHEMBL16029430 0.72 AURKA (0.51) HTTHSD17B10AURKAKCNH2ALDH1A1
SCHEMBL29368627 0.70 HTT (1.00) HTTHSD17B10AURKAALDH1A1KDM4E
SCHEMBL1311258 0.70 NPBWR1 (0.58) KCNH2NPBWR1CBFB
SCHEMBL1193064 0.70 CBFB (0.56) HTTJUNNFKB1NFKB2RELA
SCHEMBL28248112 0.70 HTT (0.40) HTTHSD17B10KDM4E
SCHEMBL11219412 0.70 HTT (1.00) HTTHSD17B10AURKAALDH1A1KDM4E
SCHEMBL22481479 0.69 DGAT1 (0.43) AURKAKCNH2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022133098-A2 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2022-06-23 WO disclosed
US-8026241-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2011-09-27 US disclosed
US-7582761-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-09-01 US disclosed
US-20090143575-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS BALAN CHENERA 2009-06-04 US disclosed
EP-1551811-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS Amgen Inc. (US) 2005-07-13 EP disclosed
US-20040152690-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2004-08-05 US disclosed
WO-2004035549-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS VANILLOID RECEPTOR LIGANDS AMGEN INC. (US) 2004-04-29 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090143575-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS TRPV1, TRPV3, TRPV2 HTT 2427/4885HSD17B10 3496/4885AURKA 1117/4885
US-20040152690-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV3, TRPV2 HTT 2624/4885HSD17B10 3754/4885AURKA 1229/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.